Geometry & MOs

Info

ID:	366162
PubChem CID:	127319571
Reduced:	ClSO3N4C17H19 (1)
Stoich.:	ABC3D4E17F19 (1)
Weight, g/mol:	370.1021
ΔH_f, kcal/mol:	-46.28
Dipole, Da:	9.35
IP(EA), eV:	-9.96(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(1,1-dioxothian-3-yl)-4-oxobutanamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)C2=NN(C(=N2)C3CC3)C4=CC=CC=C4Cl

DOS

IR

Vibrations